2-methyl-5-methylsulfonyl-4-piperidin-1-yl-benzoic acid

Systemtic Name: 2-methyl-5-methylsulfonyl-4-piperidin-1-yl-benzoic acid Openeye Name: 2-methyl-5-methylsulfonyl-4-(1-piperidyl)benzoic acid CAS Name: 2-methyl-5-methylsulfonyl-4-(1-piperidinyl)benzoic acid IUPAC Name: 2-methyl-5-methylsulfonyl-4-piperidin-1-ylbenzoic acid Traditional Name: 5-mesyl-2-methyl-4-piperidino-benzoic acid Formula: C14H19NO4S MolecularWeight: 297.36996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)O)S(=O)(=O)C)N2CCCCC2

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)O)S(=O)(=O)C)N2CCCCC2

InChI

InChI=1S/C14H19NO4S/c1-10-8-12(15-6-4-3-5-7-15)13(20(2,18)19)9-11(10)14(16)17/h8-9H,3-7H2,1-2H3,(H,16,17)